Rotigotine
TL;DR: Rotigotine (CAS 99755-59-6) is a chemical compound with molecular formula C19H25NOS and molecular weight 315.16568 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(6S)-6-[propyl(2-thiophen-2-ylethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
Also Known As: Rotigotine, Neupro, Leganto, Rotigotina, rotigotinum
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C19H25NOS |
| Molecular Weight | 315.16568 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 51.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 315.16568 Da |
| Heavy Atoms | 22 |
| Complexity | 337.0 |
| Solubility | Lipophilic and poorly soluble in water at neutral pH. Solubility increases at more acidic pH. |
| SMILES | CCCN(CCC1=CC=CS1)[C@H]2CCC3=C(C2)C=CC=C3O |
| InChIKey | KFQYTPMOWPVWEJ-INIZCTEOSA-N |
Chemical Property Profile of Rotigotine
Property Insights of Rotigotine
The XLogP value of 4.9 indicates that Rotigotine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.7 Ų, Rotigotine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Rotigotine has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Rotigotine?
The CAS number of Rotigotine is 99755-59-6.
What is the molecular formula of Rotigotine?
The molecular formula of Rotigotine is C19H25NOS.
What is the molecular weight of Rotigotine?
The molecular weight of Rotigotine is 315.16568 g/mol.
Where can I buy Rotigotine?
You can request a quote for Rotigotine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Rotigotine?
Yes, CoreyChem provides custom synthesis services for Rotigotine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.